N-(cyclohexen-1-ylmethyl)-1-[4-[(cyclohexen-1-ylmethylamino)methyl]cyclohexyl]methanamine; ethanoic acid

Systemtic Name: N-(cyclohexen-1-ylmethyl)-1-[4-[(cyclohexen-1-ylmethylamino)methyl]cyclohexyl]methanamine; ethanoic acid Openeye Name: acetic acid; N-(cyclohexen-1-ylmethyl)-1-[4-[(cyclohexen-1-ylmethylamino)methyl]cyclohexyl]methanamine CAS Name: acetic acid; N-(1-cyclohexenylmethyl)-1-[4-[(1-cyclohexenylmethylamino)methyl]cyclohexyl]methanamine IUPAC Name: acetic acid; N-(cyclohexen-1-ylmethyl)-1-[4-[(cyclohexen-1-ylmethylamino)methyl]cyclohexyl]methanamine Traditional Name: acetic acid; cyclohexen-1-ylmethyl-[[4-[(cyclohexen-1-ylmethylamino)methyl]cyclohexyl]methyl]amine Formula: C26H46N2O4 MolecularWeight: 450.65444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CC(=O)O.C1CCC(=CC1)CNCC2CCC(CC2)CNCC3=CCCCC3

Isomeric SMILES

CC(=O)O.CC(=O)O.C1CCC(=CC1)CNCC2CCC(CC2)CNCC3=CCCCC3

InChI

InChI=1S/C22H38N2.2C2H4O2/c1-3-7-19(8-4-1)15-23-17-21-11-13-22(14-12-21)18-24-16-20-9-5-2-6-10-20;2*1-2(3)4/h7,9,21-24H,1-6,8,10-18H2;2*1H3,(H,3,4)